Jove
Visualize
Contact Us
JoVE
x logofacebook logolinkedin logoyoutube logo
ABOUT JoVE
OverviewLeadershipBlogJoVE Help Center
AUTHORS
Publishing ProcessEditorial BoardScope & PoliciesPeer ReviewFAQSubmit
LIBRARIANS
TestimonialsSubscriptionsAccessResourcesLibrary Advisory BoardFAQ
RESEARCH
JoVE JournalMethods CollectionsJoVE Encyclopedia of ExperimentsArchive
EDUCATION
JoVE CoreJoVE BusinessJoVE Science EducationJoVE Lab ManualFaculty Resource CenterFaculty Site
Terms & Conditions of Use
Privacy Policy
Policies

Filters

Peter Blaha

Showing results (1-10 of 59) with videos related to

Pageof 6
Sort By:
Physical Review Letters|August 8, 2009
Accurate band gaps of semiconductors and insulators with a semilocal exchange-correlation potentialFabien Tran, Peter Blaha
The Journal of Physical Chemistry. C, Nanomaterials and Interfaces|September 1, 2015
NMR Shielding in Metals Using the Augmented Plane Wave MethodRobert Laskowski, Peter Blaha
The Journal of Physical Chemistry. A|April 13, 2017
Importance of the Kinetic Energy Density for Band Gap Calculations in Solids with Density Functional TheoryFabien Tran, Peter Blaha
Scientific Reports|October 24, 2012
Theoretical investigation of the magnetic exchange interactions in copper(II) oxides under chemical and physical pressuresXavier Rocquefelte, Karlheinz Schwarz, Peter Blaha
Journal of Physics. Condensed Matter : an Institute of Physics Journal|October 11, 2013
Hybrid functionals for solids with an optimized Hartree-Fock mixing parameterDavid Koller, Peter Blaha, Fabien Tran
Journal of Chemical Theory and Computation|October 27, 2015
How close are the Slater and Becke-Roussel potentials in solids?Fabien Tran, Peter Blaha, Karlheinz Schwarz
Physical Review Letters|December 21, 2011
Comment on "High-Tc ferroelectricity emerging from magnetic degeneracy in cupric oxide"Xavier Rocquefelte, Karlheinz Schwarz, Peter Blaha
The Journal of Chemical Physics|June 3, 2016
Rungs 1 to 4 of DFT Jacob's ladder: Extensive test on the lattice constant, bulk modulus, and cohesive energy of solidsFabien Tran, Julia Stelzl, Peter Blaha
The Journal of Physical Chemistry. C, Nanomaterials and Interfaces|September 22, 2023
DFT + <i>U</i> Simulation of the X-ray Absorption Near-Edge Structure of Bulk UO<sub>2</sub> and PuO<sub>2</sub>Jia-Li Chen, Peter Blaha, Nikolas Kaltsoyannis
Inorganic Chemistry|July 10, 2013
Structural, spectroscopic, and computational studies on Tl4Si5O12: a microporous thallium silicateVolker Kahlenberg, Lukas Perfler, Jürgen Konzett, et al.
Pageof 6

Showing results (1-10 of 59) with videos related to

Sort By:
Pageof 6
Physical Review Letters|August 8, 2009
Accurate band gaps of semiconductors and insulators with a semilocal exchange-correlation potentialFabien Tran, Peter Blaha
The Journal of Physical Chemistry. C, Nanomaterials and Interfaces|September 1, 2015
NMR Shielding in Metals Using the Augmented Plane Wave MethodRobert Laskowski, Peter Blaha
The Journal of Physical Chemistry. A|April 13, 2017
Importance of the Kinetic Energy Density for Band Gap Calculations in Solids with Density Functional TheoryFabien Tran, Peter Blaha
Scientific Reports|October 24, 2012
Theoretical investigation of the magnetic exchange interactions in copper(II) oxides under chemical and physical pressuresXavier Rocquefelte, Karlheinz Schwarz, Peter Blaha
Journal of Physics. Condensed Matter : an Institute of Physics Journal|October 11, 2013
Hybrid functionals for solids with an optimized Hartree-Fock mixing parameterDavid Koller, Peter Blaha, Fabien Tran
Journal of Chemical Theory and Computation|October 27, 2015
How close are the Slater and Becke-Roussel potentials in solids?Fabien Tran, Peter Blaha, Karlheinz Schwarz
Physical Review Letters|December 21, 2011
Comment on "High-Tc ferroelectricity emerging from magnetic degeneracy in cupric oxide"Xavier Rocquefelte, Karlheinz Schwarz, Peter Blaha
The Journal of Chemical Physics|June 3, 2016
Rungs 1 to 4 of DFT Jacob's ladder: Extensive test on the lattice constant, bulk modulus, and cohesive energy of solidsFabien Tran, Julia Stelzl, Peter Blaha
The Journal of Physical Chemistry. C, Nanomaterials and Interfaces|September 22, 2023
DFT + <i>U</i> Simulation of the X-ray Absorption Near-Edge Structure of Bulk UO<sub>2</sub> and PuO<sub>2</sub>Jia-Li Chen, Peter Blaha, Nikolas Kaltsoyannis
Inorganic Chemistry|July 10, 2013
Structural, spectroscopic, and computational studies on Tl4Si5O12: a microporous thallium silicateVolker Kahlenberg, Lukas Perfler, Jürgen Konzett, et al.
Pageof 6